SCHEMBL7399741

SCHEMBL7399741

NCCc1ccc(NC(=O)C2CCN(c3ccncc3)CC2)cc1

nearest known ligand 0.63

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F10 P00742 17/20 0.63
GLA P06280 1/20 0.56
LMNA P02545 1/20 0.55
TP53 P04637 1/20 0.55
MAPT P10636 1/20 0.55
F2 P00734 2/20 0.55
ELANE P08246 1/20 0.55

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL7406788 0.91 F10 (0.62) F10GLAF2ELANE
Hydrochloric Acid SCHEMBL7399543 0.89 F10 (0.61) F10GLAF2ELANE
Hydrochloric Acid SCHEMBL9409439 0.86 F10 (0.61) F10GLALMNATP53MAPT
SCHEMBL7392845 0.85 F10 (0.59) F10GLAF2ELANE
SCHEMBL9409519 0.84 F10 (0.59) F10GLALMNATP53MAPT
Hydrochloric Acid SCHEMBL7336365 0.84 F10 (0.58) F10GLAF2ELANE
SCHEMBL7400450 0.83 F10 (0.57) F10GLALMNATP53MAPT
SCHEMBL7399745 0.82 F10 (0.59) F10GLAMAPTF2ELANE
Hydrochloric Acid SCHEMBL7332238 0.81 F10 (0.58) F10GLAMAPTF2ELANE
SCHEMBL23928217 0.80 POLB (0.55) GLALMNATP53MAPT

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5563141-A INHIBIT CELL ADHESION FOR EXAMPLE, PLATELET AGGRE GATION ZENECA LIMITED (GB) 1996-10-08 US disclosed
EP-0690847-A1 HETEROCYCLIC COMPOUNDS AS PLATELET AGGREGATION INHIBITORS ZENECA LIMITED (GB) 1996-01-10 EP disclosed
WO-1994022835-A2 HETEROCYCLIC COMPOUNDS AS PLATELET AGGREGATION INHIBITORS ZENECA LIMITED (GB) 1994-10-13 WO disclosed